1180512-23-5
(3R*,4R*)-1-BENZYL-4-(2-NITRO-PHENYLAMINO)-PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
Name
(3R*,4R*)-1-BENZYL-4-(2-NITRO-PHENYLAMINO)-PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
Formula
C21 H25 N3 O4
MolWeight
383.445
1Identification
【Name】
(3R*,4R*)-1-BENZYL-4-(2-NITRO-PHENYLAMINO)-PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD12963625
【English Synonyms】
【Formula】
C21 H25 N3 O4
【MolWeight】
383.445
【Inchi】
InChI=1S/C21H25N3O4/c1-2-28-21(25)17-15-23(14-16-8-4-3-5-9-16)13-12-18(17)22-19-10-6-7-11-20(19)24(26)27/h3-11,17-18,22H,2,12-15H2,1H3/t17-,18-/m1/s1
【InChIKey】
InChIKey=YHOLZCWNOCPMTC-QZTJIDSGSA-N
【SMILES】
CCOC(=O)[C@@H]1CN(CC[C@H]1Nc2ccccc2[N+](=O)[O-])Cc3ccccc3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3R*,4R*)-1-BENZYL-4-(2-NITRO-PHENYLAMINO)-PIPERIDINE-3-CARBOXYLIC ACID ETHYL ESTER.cml
Quick Release
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